4-Methylcyclohexanol

Basic Information

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CAS Number

589-91-3

Molecular Formula

C7H14O

Molecular Weight

114.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

-41 ºC

Boiling Point

171-173 °C

Refractive Index

n20/D 1.458(lit.)

Vapor Pressure

1.5 mmHg ( 30 °C)

SMILES

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CC1CCC(CC1)O

InChI

InChI=1S/C7H14O/c1-6-2-4-7(8)5-3-6/h6-8H,2-5H2,1H3

InChIKey

MQWCXKGKQLNYQG-UHFFFAOYSA-N

LogP

1.5574

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

62.8

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H336 May cause drowsiness or dizziness
Specific target organ toxicity, single exposure; Narcotic effects

Synonyms & References

English

UNII-1UK9W4X7H9
trans-4-methylcyclohexan-1-ol
A832098
Methyl cyclohexanol
4-methylcyclohexyl alcohol
cis-4-Methylcyclohexanol, 98%
UNII-JUW70559WV
p-Methylcyclohexanol
4-Methylcyclohexanol, trans-
M0354
trans-4-Methylcyclohexanol, 97%
4-Methylcyclohexanol, (E)-
FT-0619074
SCHEMBL11799
7731-28-4
MFCD00064171
4-Methylcyclohexanol, cis + trans, 98%
4-methyl-1-cyclohexanol
NS00022439
NSC 3714
4-Methylcyclohexanol, (Z)-
MFCD00064170
NS00081388
DTXSID301032962
BDBM36193
4-Methylcyclohexanol cis+trans
F8880-5214
AM9714
Cyclohexanol, 4-methyl-, trans-
CS-0180938
Q-200498

MDL Number

MFCD00001449

Customs Code

2906120010

FAQ

What is 4-Methylcyclohexanol (CAS: 589-91-3)?

4-Methylcyclohexanol is a cyclic alcohol with the molecular formula C7H14O. It is a colorless to light yellow, flammable liquid with a mild, distinctive odor. It is used in various applications including pharmaceuticals, fragrances, and as a solvent.

What are the main uses of 4-Methylcyclohexanol (CAS: 589-91-3)?

4-Methylcyclohexanol is primarily used in the production of fragrances and perfumes, as a flavorant in the food industry, and as a solvent in various chemical processes. It also finds applications in pharmaceuticals for the synthesis of drug intermediates.

Is 4-Methylcyclohexanol (CAS: 589-91-3) safe?

4-Methylcyclohexanol is generally considered safe under proper handling conditions. However, it should be handled with care as it is flammable and may cause skin and eye irritation. Adequate ventilation and appropriate personal protective equipment (PPE) should be used to minimize exposure. In case of skin contact, flush with water and seek medical advice if necessary.

How should 4-Methylcyclohexanol (CAS: 589-91-3) be stored?

4-Methylcyclohexanol should be stored in a cool, dry place away from direct sunlight and sources of ignition. It should be kept in a tightly sealed container to prevent evaporation and contamination. Store it at room temperature or below 25°C to maintain its stability and safety. Avoid exposure to high humidity and direct sunlight to prevent degradation.